HMDB0258493 RDKit 3D 2-Lysophosphatidylcholine 89 88 0 0 0 0 0 0 0 0999 V2000 -12.1670 -0.7201 -1.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8034 -2.0463 -0.6054 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3574 -2.0627 0.7868 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1417 -1.4455 1.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7612 -0.0542 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5348 0.7611 0.0926 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5129 0.2401 -0.8586 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1744 0.0742 -0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5639 1.3374 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2002 1.1642 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2309 0.6384 -0.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8381 0.4744 0.5109 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9626 -0.0638 -0.5991 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5803 -0.2747 -0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0609 0.9744 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1839 2.0414 -0.6399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9884 1.6525 -1.8319 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4013 1.2995 -1.5285 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1205 0.8736 -2.4801 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9274 1.4249 -0.2642 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2569 1.0914 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4838 -0.3659 -0.2401 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6303 -1.1752 0.5268 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9108 -0.7107 0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0269 -0.4376 1.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5476 -0.7674 2.1358 P 0 0 0 0 0 5 0 0 0 0 0 0 7.5270 -0.4313 3.6186 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9021 -2.4202 1.9488 O 0 0 0 0 0 1 0 0 0 0 0 0 8.7431 0.2038 1.4386 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6840 -0.6466 0.8606 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7752 0.1954 0.2273 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7885 -0.6372 -0.3940 N 0 0 0 0 0 4 0 0 0 0 0 0 12.6173 0.1282 -1.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1850 -1.7310 -1.1375 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6380 -1.2250 0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0451 -0.8005 -1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3419 -0.3794 -1.8267 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3598 0.0550 -0.4174 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1072 -2.6173 -1.2905 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7552 -2.6792 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-2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2712 -0.5837 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2609 0.8547 -0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9441 -2.2059 -1.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4157 -1.2826 -1.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7693 -2.5081 -0.4722 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5996 -1.5863 0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8263 -0.4657 1.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1194 -2.0849 1.0853 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 26 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 32 35 1 0 1 36 1 0 1 37 1 0 1 38 1 0 2 39 1 0 2 40 1 0 3 41 1 0 3 42 1 0 4 43 1 0 4 44 1 0 5 45 1 0 5 46 1 0 6 47 1 0 6 48 1 0 7 49 1 0 7 50 1 0 8 51 1 0 8 52 1 0 9 53 1 0 9 54 1 0 10 55 1 0 10 56 1 0 11 57 1 0 11 58 1 0 12 59 1 0 12 60 1 0 13 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 15 65 1 0 15 66 1 0 16 67 1 0 16 68 1 0 17 69 1 0 17 70 1 0 21 71 1 0 21 72 1 0 22 73 1 0 23 74 1 0 24 75 1 0 24 76 1 0 30 77 1 0 30 78 1 0 31 79 1 0 31 80 1 0 33 81 1 0 33 82 1 0 33 83 1 0 34 84 1 0 34 85 1 0 34 86 1 0 35 87 1 0 35 88 1 0 35 89 1 0 M CHG 2 28 -1 32 1 M END